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Substance Name: Elagolix sodium [USAN]
RN: 832720-36-2
UNII: 5948VUI423
InChIKey: DQYGXRQUFSRDCH-UQIIZPHYSA-M

Note

  • An orally available nonpeptide GnRH antagonist.

Molecular Formula

  • C32-H29-F5-N3-Na-O5

Molecular Weight

  • 653.5771
 

Classification Codes

  • Management of Benign Prostatic Hyperplasia
  • Management of Endometriosis
  • Management of Hormone-Dependent Diseases such as Endometriosis, Uterine Fibroids, Prostate Cancer, and Benign Prostatic Hyperplasia
  • Management of Prostate Cancer
  • Management of Uterine Fibroids
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Names and Synonyms

Name of Substance

  • Elagolix sodium [USAN]

Synonyms

  • Elagolix sodium
  • NBI-56418 Na
  • Sodium 4-(((1R)-2-(5-(2-fluoro-3-methoxyphenyl)-3-((2-fluoro-6-(trifluoromethyl)phenyl)methyl)-4-methyl-2,6-dioxo-3,6-dihydropyrimidin-1(2H)-yl)-1-phenylethyl)amino)butanoate
  • UNII-5948VUI423

Systematic Name

  • Butanoic acid, 4-(((1R)-2-(5-(2-fluoro-3-methoxyphenyl)-3-((2-fluoro-6-(trifluoromethyl)phenyl)methyl)-3,6-dihydro-4-methyl-2,6-dioxo-1(2H)-pyrimidinyl)-1-phenylethyl)amino)-, monosodium salt

Registry Numbers

CAS Registry Number

  • 832720-36-2

FDA UNII

  • 5948VUI423

System Generated Number

  • 0832720362

Structure Descriptors

InChI

1S/C32H30F5N3O5.Na/c1-19-28(21-11-6-14-26(45-2)29(21)34)30(43)40(18-25(20-9-4-3-5-10-20)38-16-8-15-27(41)42)31(44)39(19)17-22-23(32(35,36)37)12-7-13-24(22)33;/h3-7,9-14,25,38H,8,15-18H2,1-2H3,(H,41,42);/q;+1/p-1/t25-;/m0./s1

InChIKey

DQYGXRQUFSRDCH-UQIIZPHYSA-M

Smiles

[Na+].COc1cccc(C2=C(C)N(Cc3c(F)cccc3C(F)(F)F)C(=O)N(C[C@H](NCCCC(=O)[O-])c4ccccc4)C2=O)c1F